Geometry & MOs

Info

ID:	359520
PubChem CID:	127298794
Reduced:	ON2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	253.215413
ΔH_f, kcal/mol:	-70.54
Dipole, Da:	7.08
IP(EA), eV:	-8.85(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethylpiperazin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone

Drug info:

PubChemData

Smile

CC1CN(CCN1CC(=O)NCC2=CC=C(C=C2)C(=O)N3CCCC3)C

DOS

IR

Vibrations